Home Other Building Blocks 2-(3-acetylphenyl)-4-methyl-1,2-thiazolidine-1,1-dione

2-(3-acetylphenyl)-4-methyl-1,2-thiazolidine-1,1-dione

CAS No.:
1502731-71-6
Catalog Number:
AG01AFJ2
Molecular Formula:
C12H15NO3S
Molecular Weight:
253.3174
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Product Description
Catalog Number:
AG01AFJ2
Chemical Name:
2-(3-acetylphenyl)-4-methyl-1,2-thiazolidine-1,1-dione
CAS Number:
1502731-71-6
Molecular Formula:
C12H15NO3S
Molecular Weight:
253.3174
MDL Number:
MFCD24755799
IUPAC Name:
1-[3-(4-methyl-1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]ethanone
InChI:
InChI=1S/C12H15NO3S/c1-9-7-13(17(15,16)8-9)12-5-3-4-11(6-12)10(2)14/h3-6,9H,7-8H2,1-2H3
InChI Key:
AVRHCRBJGROKLE-UHFFFAOYSA-N
SMILES:
CC1CN(S(=O)(=O)C1)c1cccc(c1)C(=O)C
Properties
Complexity:
399  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.316g/mol
Monoisotopic Mass:
253.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties